Lignin_cw_compound_1024 (C32 H32 O11)

bmse010278 Data

Entry STAR file: bmse010278.str

NMR-STAR interactive viewer

Authors: Sally Ralph, John Ralph, Larry L. Landucci

From: NMR Database of Lignin and Cell Wall Model Compounds.

Natural Isotopic formula weight: 592.58988

This is of the category: More Trimers Containing Ferulic, Coumaric or p-OH-Benzoic Acid

Concentration: Saturated (Source: Richard F. Helm)

Spectrometer: Bruker DRX - 360 MHz

Graphical representations:

View large 3D structure

Lignin_cw_compound_1024 image

Assigned chemical shifts

Solvent: acetone
Atom IDAuthor NomenclatureValueAmbiguity Code
C1AcMe20.614
C2AcMe20.874
C3AcMe20.964
C4OMe56.204
C5OMe56.284
C19G63.001
C32A74.601
C30B80.321
C18A2112.771
C8B2113.791
C17CB117.951
C9B5119.821
C13A6120.451
C7B6121.641
C14C3123.311
C15C5123.311
C16A5123.451
C6B1124.061
C10C2130.441
C11C6130.441
C23C1132.731
C24A1136.781
C28A4140.711
C12CA146.021
C27B4148.271
C26B3152.061
C29A3152.191
C28C4153.741
C31CG164.951
C20AcC=O169.424
C21AcC=O169.924
C22AcC=O170.764
H65CA7.841
H70CB6.741
H75A6.101
H74B4.851
H72G14.391
H73G24.241